![[4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea structure](/static/products/2302/2302-89-8.webp)
[4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea
TL;DR: [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea (CAS 2302-89-8) is a chemical compound with molecular formula C14H23N3O and molecular weight 249.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea
Also Known As: 4-3-buten-2-onesemicarbazone, [4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea
| Molecular Formula | C14H23N3O |
|---|---|
| Molecular Weight | 249.18 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.18411 |
| Heavy Atoms | 18 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 2302-89-8 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)C=CC(=NNC(=O)N)C |
| InChIKey | KONFNVUQMJEATQ-UHFFFAOYSA-N |
Product Overview
[4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea (CAS 2302-89-8), with molecular formula C14H23N3O and molecular weight 249.18 g/mol. IUPAC: [4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea.
Chemical Property Profile of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea
Property Insights of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea. Following Lipinski's Rule of Five, [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea?
The CAS number of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea is 2302-89-8.
What is the molecular formula of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea?
The molecular formula of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea is C14H23N3O.
What is the molecular weight of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea?
The molecular weight of [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea is 249.18 g/mol.
Where can I buy [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea?
You can request a quote for [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for [4-(2,6,6-Trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.